SCHEMBL22563845

SCHEMBL22563845

O=C(O)c1cccc(CF)c1COc1ccn(S)n1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.34
NR1H4 Q96RI1 4/20 0.34
MRGPRX4 Q96LA9 11/20 0.34
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
HTT P42858 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22564506 0.89 MEN1 (0.35)
SCHEMBL22564084 0.89 ALDH1A1 (0.31) NR1H4ALDH1A1
SCHEMBL22563884 0.89 FOLH1 (0.32) FOLH1NR1H4
SCHEMBL22563970 0.89 MRGPRX4 (0.39) FOLH1NR1H4MRGPRX4ALDH1A1TP53
SCHEMBL22564378 0.87 PDE5A (0.31)
SCHEMBL22564543 0.87 SMN1; SMN2 (0.33) ALDH1A1HTT
SCHEMBL22563909 0.87 ALDH1A1 (0.34) MRGPRX4ALDH1A1TP53HTT
SCHEMBL18504157 0.87 NR1H4 (0.35) FOLH1NR1H4MRGPRX4ALDH1A1TP53
SCHEMBL22564127 0.86
SCHEMBL22564276 0.86 FOLH1 (0.35) FOLH1NR1H4MRGPRX4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed